Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=CC=CC=C1.COC1=CC=CC(OC(=O)NC2=CC3=C(SC(C)=C3CCN(C)CC3=NN=CC(=C3)N(C)C)C=C2)=C1

InChIKey

InChIKey=RTVBPRIZQBMAOZ-UHFFFAOYSA-N

Formula

C34H37N5O5S

Mass

627.76

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiophenes

Subclass

1-benzothiophenes

Intermediate Tree Nodes

Not available

Direct Parent

1-benzothiophenes

Alternative Parents

Benzoic acids Phenoxy compounds Methoxybenzenes Dialkylarylamines Anisoles Benzoyl derivatives Alkyl aryl ethers Aminopyridazines Aralkylamines Thiophenes Heteroaromatic compounds Carbamate esters Trialkylamines Carboxylic acids Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives

Molecular Framework

Not available

Substituents

Benzoic acid or derivatives - Benzoic acid - 1-benzothiophene - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Methoxybenzene - Aralkylamine - Aminopyridazine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Pyridazine - Carbamic acid ester - Heteroaromatic compound - Thiophene - Tertiary aliphatic amine - Tertiary amine - Ether - Carboxylic acid - Carboxylic acid derivative - Azacycle - Carbonyl group - Amine - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-benzothiophenes. These are aromatic heterocyclic compound containing the Benzo[b]thiophene ring system.

External Descriptors

Not available

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